5,6-dimethoxy-N-(2-methoxy-4-nitro-phenyl)-1,3-benzothiazol-2-amine

Systemtic Name: 5,6-dimethoxy-N-(2-methoxy-4-nitro-phenyl)-1,3-benzothiazol-2-amine Openeye Name: 5,6-dimethoxy-N-(2-methoxy-4-nitro-phenyl)-1,3-benzothiazol-2-amine CAS Name: 5,6-dimethoxy-N-(2-methoxy-4-nitrophenyl)-1,3-benzothiazol-2-amine IUPAC Name: 5,6-dimethoxy-N-(2-methoxy-4-nitrophenyl)-1,3-benzothiazol-2-amine Traditional Name: (5,6-dimethoxy-1,3-benzothiazol-2-yl)-(2-methoxy-4-nitro-phenyl)amine Formula: C16H15N3O5S MolecularWeight: 361.3724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC2=NC3=CC(=C(C=C3S2)OC)OC

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC2=NC3=CC(=C(C=C3S2)OC)OC

InChI

InChI=1S/C16H15N3O5S/c1-22-12-6-9(19(20)21)4-5-10(12)17-16-18-11-7-13(23-2)14(24-3)8-15(11)25-16/h4-8H,1-3H3,(H,17,18)